SCHEMBL27859464

SCHEMBL27859464

CCCCCOc1c(CCCC)ccc(OCC)c1OCCCCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ MAPT P10636 4/20 0.36
▸ NPSR1 Q6W5P4 4/20 0.36
▸ HTT P42858 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAD52 P43351 1/20 0.36
▸ TYR P14679 1/20 0.35
▸ NR5A1 Q13285 1/20 0.35
▸ THRB P10828 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ CNR2 P34972 3/20 0.35
▸ APAF1 O14727 1/20 0.35
▸ LTA4H P09960 1/20 0.34
▸ ALOX5 P09917 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27841893 0.84 TYR (0.40) MAPTHTTMEN1KMT2ATYR
SCHEMBL8225071 0.82 L3MBTL1 (0.47) L3MBTL1MAPTNPSR1MEN1KMT2A
SCHEMBL8227403 0.81 L3MBTL1 (0.43) L3MBTL1MAPTNPSR1HTTMEN1
SCHEMBL28302486 0.81 ALOX5 (0.42) MAPTHTTMEN1KMT2ATYR
Propene SCHEMBL27508599 0.80 CNR2 (0.37) L3MBTL1MAPTNPSR1HTTMEN1
SCHEMBL5256543 0.78 MAPT (0.38) MAPTNPSR1HTTMEN1KMT2A
SCHEMBL28490785 0.77 PTGES (0.46) ALOX5
SCHEMBL20339635 0.77 MAPT (0.43) MAPTNPSR1MEN1KMT2ANR5A1
SCHEMBL8223215 0.76 CYP1A2 (0.47) L3MBTL1MAPTNPSR1MEN1KMT2A
SCHEMBL27956894 0.75 MEN1 (0.44) MAPTNPSR1HTTMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102271732-A Nanochannel devices and related methods — 2011-12-07 — — CN disclosed
Send feedback